4,5-bis(bromanyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]thiophene-2-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]thiophene-2-carboxamide Openeye Name: 4,5-dibromo-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]thiophene-2-carboxamide CAS Name: 4,5-dibromo-N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-2-thiophenecarboxamide IUPAC Name: 4,5-dibromo-N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]thiophene-2-carboxamide Traditional Name: 4,5-dibromo-N-[4-(4-ethylpiperazino)-2-methyl-phenyl]thiophene-2-carboxamide Formula: C18H21Br2N3OS MolecularWeight: 487.25184

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC(=C(S3)Br)Br)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC(=C(S3)Br)Br)C

InChI

InChI=1S/C18H21Br2N3OS/c1-3-22-6-8-23(9-7-22)13-4-5-15(12(2)10-13)21-18(24)16-11-14(19)17(20)25-16/h4-5,10-11H,3,6-9H2,1-2H3,(H,21,24)